7-Chloro-1-indanone - CAS 34911-25-6

Catalog:	BB022356
Product Name:	7-Chloro-1-indanone
CAS:	34911-25-6
Synonyms:	7-chloro-2,3-dihydroinden-1-one; 7-chloro-2,3-dihydroinden-1-one

Technical Data

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Computed Properties

IUPAC Name:	7-chloro-2,3-dihydroinden-1-one
Description:	7-Chloro-1-indanone (CAS# 34911-25-6) is a reagent used to synthesize tetracyclic quinoline and quinoxaline carboxamides which are used as therapeutic topoisomerase inhibitors.
Molecular Weight:	166.60
Molecular Formula:	C9H7ClO
Canonical SMILES:	C1CC(=O)C2=C1C=CC=C2Cl
InChI:	InChI=1S/C9H7ClO/c10-7-3-1-2-6-4-5-8(11)9(6)7/h1-3H,4-5H2
InChI Key:	YNFZQNGHYQYLCF-UHFFFAOYSA-N
Boiling Point:	288.2 °C at 760 mmHg
Density:	1.312 g/cm³
Appearance:	Solid
MDL:	MFCD06796576
LogP:	2.46890

Publication Number	Title	Priority Date
WO-2021190727-A1	Compounds and their use in the treatment of bacterial infection	20200324
CN-111205175-A	Synthetic method for improving yield of 5-chloro-1-indanone	20200317
CN-111454137-A	Synthetic method for improving yield of 5-chloro-1-indanone	20200317
WO-2020146636-A1	Compounds and methods for treating or preventing heart failure	20190109
CA-3016124-A1	Carbamate derivative compounds, processes for preparing them and their uses	20160229

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[87-88-7]
Chloranilic acid
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[55441-25-3]
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[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	178
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	166.0185425
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	166.0185425
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3